AB01301805-01
TL;DR: AB01301805-01 (CAS 892639-31-5) is a chemical compound with molecular formula C16H15N3O3S and molecular weight 329.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-methyl-4-oxo-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)chromene-2-carboxamide
Also Known As: AB01301805-01, 7-methyl-4-oxo-N-[(2Z)-5-(propan-2-yl)-1,3,4-thiadiazol-2(3H)-ylidene]-4H-chromene-2-carboxamide, 7-methyl-4-oxo-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)chromene-2-carboxamide, 7-methyl-4-oxo-N-[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]-4H-chromene-2-carboxamide, N-(5-isopropyl-1,3,4-thiadiazol-2-yl)-7-methyl-4-oxo-4H-chromene-2-carboxamide
| Molecular Formula | C16H15N3O3S |
|---|---|
| Molecular Weight | 329.08 g/mol |
| LogP | 3.32862 |
| Topological Polar Surface Area | 85.09 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 329.0834 |
| Heavy Atoms | 23 |
| Complexity | 943.1386 |
Chemical Identifiers
| CAS Number | 892639-31-5 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)C(=O)C=C(O2)C(=O)NC3=NN=C(S3)C(C)C |
Product Overview
AB01301805-01 (CAS 892639-31-5), with molecular formula C16H15N3O3S and molecular weight 329.08 g/mol. IUPAC: 7-methyl-4-oxo-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)chromene-2-carboxamide.
Chemical Property Profile of AB01301805-01
Property Insights of AB01301805-01
The XLogP value of 3.32862 indicates that AB01301805-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.09 Ų falls within the moderate polarity range, balancing permeability and solubility for AB01301805-01. Following Lipinski's Rule of Five, AB01301805-01 has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AB01301805-01?
The CAS number of AB01301805-01 is 892639-31-5.
What is the molecular formula of AB01301805-01?
The molecular formula of AB01301805-01 is C16H15N3O3S.
What is the molecular weight of AB01301805-01?
The molecular weight of AB01301805-01 is 329.08 g/mol.
Where can I buy AB01301805-01?
You can request a quote for AB01301805-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB01301805-01?
Yes, KEHONG BIO provides custom synthesis services for AB01301805-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.